| Category | Software/Languages |
| Machine learning and Data Science | Pandas, Numpy, scikit-Learn, Matplot, seaborn |
| Programming Languages | Python, C, C++, Java, Perl, C#, JavaScript, TCL scripting, PHP |
| Chemo/Bioinformatics | Schrödinger Maestro, Cambridge Chemdraw, Accelrys Discovery studio, Gaussian, LigandScout, Modeller |
| Molecular Docking | Autodock, Schrödinger Glide |
| Molecular Dynamics | AMBER, GROMACS, NAMD |
| ADME/T prediction | ACD/Labs, Topkat, Qikprop |
| Visualization Software | Pymol, VMD, Chimera |
| Operating Systems | Windows, Linux, Cluster computing |
| IDE | Jupyter Notebook, RStudio, NetBeans, VS Code |
| Others | WAMP server, StarDrop, AWS, Github |